| Literature DB >> 22107406 |
Douwe Jan Bonthuis1, Stephan Gekle, Roland R Netz.
Abstract
The framework for deriving tensorial interfacial dielectric profiles from bound charge distributions is established and applied to molecular dynamics simulations of water at hydrophobic and hydrophilic surfaces. In conjunction with a modified Poisson-Boltzmann equation, the trend of experimental double-layer capacitances is well reproduced. We show that the apparent Stern layer can be understood in terms of the dielectric profile of pure water.Entities:
Year: 2011 PMID: 22107406 DOI: 10.1103/PhysRevLett.107.166102
Source DB: PubMed Journal: Phys Rev Lett ISSN: 0031-9007 Impact factor: 9.161